4-(2-Chloro-4-pyrimidinyl)benzoic acid

CAS Registry Number®

281232-89-1

CAS Name

4-(2-Chloro-4-pyrimidinyl)benzoic acid

Molecular Formula

C11H7ClN2O2

Molecular Mass

234.64

Cite this Page

4-(2-Chloro-4-pyrimidinyl)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=281232-89-1 (retrieved 2024-10-05) (CAS RN: 281232-89-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H7ClN2O2/c12-11-13-6-5-9(14-11)7-1-3-8(4-2-7)10(15)16/h1-6H,(H,15,16)

InChIKey

InChIKey=PIFZVVITMGNVMA-UHFFFAOYSA-N

SMILES

ClC=1N=C(C2=CC=C(C(O)=O)C=C2)C=CN1

Canonical SMILES

O=C(O)C=1C=CC(=CC1)C2=NC(Cl)=NC=C2

Other Names for this Substance

  • Benzoic acid, 4-(2-chloro-4-pyrimidinyl)-
  • 4-(2-Chloro-4-pyrimidinyl)benzoic acid
  • 4-(2-Chloropyrimidin-4-yl)benzoic acid

CAS INSIGHTSTM
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